Molecular Structure:
CCD No.:CCD00218367
VITAS-BB TBB016043
Formula:C22H30N2O3S
MolWeight:402.556
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| Product Name： | VITAS-BB TBB016043 |
| English Synonyms： | VITAS-BB TBB016043 |
| MDL Number.： | MFCD01353602 |
| H bond acceptor： | 5 |
| H bond donor： | 2 |
| Smile： | CCC(C)(C)C1CCC2=C(C1)SC(NC(=O)C1CCCCC1C(O)=O)=C2C#N |
| InChi： | InChI=1S/C22H30N2O3S/c1-4-22(2,3)13-9-10-14-17(12-23)20(28-18(14)11-13)24-19(25)15-7-5-6-8-16(15)21(26)27/h13,15-16H,4-11H2,1-3H3,(H,24,25)(H,26,27) |
| InChiKey： | InChIKey=VQOQZXAILINBCF-UHFFFAOYSA-N |
Basic Information
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